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[BUG] ImportError: cannot import name 'ParamSpec' from 'typing_extensions'
#158
opened Mar 28, 2024 by
yanz-24
Only MDAnalysis superpose alghorithms worked while MMLigner and TheseusAligner did not.
#154
opened May 11, 2023 by
njbamboo
TheseusAligner performs a wrong tranformation
module-structure-superposition
Concerns opencadd.structure.superposition module
#113
opened Oct 31, 2021 by
pipaj97
MDAnalysis 2.0.0: Structures fetched by PDB code do not contain elements
module-structure
Concers opencadd.structure module
#93
opened Aug 27, 2021 by
dominiquesydow
Use redo to query KLIFS database
module-databases-klifs
Concerns opencadd.databases.klifs module
#82
opened Jul 6, 2021 by
dominiquesydow
Automatize local KLIFS IDs copy (needed for local session)
module-databases-klifs
Concerns opencadd.databases.klifs module
#81
opened Jul 1, 2021 by
dominiquesydow
Change logging level INFO to DEBUG
module-structure-pocket
Concerns opencadd.structure.pocket module
#79
opened Jun 30, 2021 by
dominiquesydow
superposer is insenstive to residues with insertion codes
module-structure-superposition
Concerns opencadd.structure.superposition module
#56
opened Dec 1, 2020 by
dominiquesydow
opencadd README: Add list of external resources
documentation
Improvements or additions to documentation
#52
opened Oct 23, 2020 by
dominiquesydow
opencadd.structure.pocket: Add features to nglview views
module-structure-pocket
Concerns opencadd.structure.pocket module
#49
opened Oct 21, 2020 by
dominiquesydow
Update biopandas usage: Read pdb from list of strings
module-io
Concerns opencadd.io module
#48
opened Oct 21, 2020 by
dominiquesydow
Slow performance of atom selection with MDAnalysis
module-structure-superposition
Concerns opencadd.structure.superposition module
#47
opened Sep 28, 2020 by
dominiquesydow
Unpin biopython and update Bio.Alphabet usage
module-structure-superposition
Concerns opencadd.structure.superposition module
#46
opened Sep 9, 2020 by
jaimergp
ASCONA
enhancement
New feature or request
module-structure-superposition
Concerns opencadd.structure.superposition module
#35
opened Jun 5, 2020 by
jaimergp
Overview of different methods and servers
enhancement
New feature or request
module-structure-superposition
Concerns opencadd.structure.superposition module
#31
opened Apr 29, 2020 by
jaimergp
Methods inspired by Pymol
enhancement
New feature or request
module-structure-superposition
Concerns opencadd.structure.superposition module
#28
opened Apr 21, 2020 by
jaimergp
Provide selection API for partial alignment
enhancement
New feature or request
module-structure-superposition
Concerns opencadd.structure.superposition module
#26
opened Apr 20, 2020 by
jaimergp
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